[4-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]phenyl]methyl-diethyl-azanium Openeye Name: [4-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[(3,6-dichloro-1-benzothiophen-2-yl)-oxomethyl]amino]phenyl]methyl-diethylammonium IUPAC Name: [4-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]phenyl]methyl-diethylazanium Traditional Name: [4-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]benzyl]-diethyl-ammonium Formula: C20H21Cl2N2OS+ MolecularWeight: 408.36454

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H20Cl2N2OS/c1-3-24(4-2)12-13-5-8-15(9-6-13)23-20(25)19-18(22)16-10-7-14(21)11-17(16)26-19/h5-11H,3-4,12H2,1-2H3,(H,23,25)/p+1